2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide

C22H24N2O4 — CID 55354188

IUPAC2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CN(Cc2ccccc2)Cc2ccco2)cc(OC)c1
InChIInChI=1S/C22H24N2O4/c1-26-20-11-18(12-21(13-20)27-2)23-22(25)16-24(15-19-9-6-10-28-19)14-17-7-4-3-5-8-17/h3-13H,14-16H2,1-2H3,(H,23,25)
InChIKeyHAGMXZNKOKEUFK-UHFFFAOYSA-N
MW380.44 g/mol
LogP3.94
Rot. Bonds9

About 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide

2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide (PubChem CID 55354188) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
PubChem CID55354188
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC Name2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
SMILESCOc1cc(NC(=O)CN(Cc2ccccc2)Cc2ccco2)cc(OC)c1
InChIInChI=1S/C22H24N2O4/c1-26-20-11-18(12-21(13-20)27-2)23-22(25)16-24(15-19-9-6-10-28-19)14-17-7-4-3-5-8-17/h3-13H,14-16H2,1-2H3,(H,23,25)
InChIKeyHAGMXZNKOKEUFK-UHFFFAOYSA-N
XLogP3.94
TPSA63.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-cyanoethyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
CID 78822926
3-[benzyl(ethyl)amino]-N-(3,5-dimethoxyphenyl)propanamide
CID 1340180
methyl 2-[benzyl-[2-(4-methoxyanilino)-2-oxoethyl]amino]acetate
CID 60565339
2-[benzyl(furan-2-ylmethyl)amino]-N-[4-(difluoromethylsulfanyl)phenyl]acetamide
CID 55354166
2-[2-aminoethyl(2-phenylethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide;hydrochloride
CID 120872401
2-[benzyl(furan-2-ylmethyl)amino]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide
CID 18271937
N-(3-acetylphenyl)-2-[bis(furan-2-ylmethyl)amino]acetamide
CID 8840674
N,N-bis(furan-2-ylmethyl)-1-phenylmethanamine
CID 10825735
N-benzyl-2-[cyclopropyl-[(3-methoxyphenyl)carbamoyl]amino]-N-(furan-2-ylmethyl)acetamide
CID 1058435
N-benzyl-N-(furan-2-ylmethyl)-2-[(3-methoxyphenyl)carbamoyl-propan-2-ylamino]acetamide
CID 4189347
2-[bis(furan-2-ylmethyl)amino]-N-methylacetamide
CID 27118866
N-cyclopropyl-4-[[[2-(3,4-dimethoxyanilino)-2-oxoethyl]-(furan-2-ylmethyl)amino]methyl]benzamide
CID 30798231

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide?
The IUPAC name of 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide (CID 55354188) is 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide.
What is the SMILES notation for 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide?
The canonical SMILES for 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide is COc1cc(NC(=O)CN(Cc2ccccc2)Cc2ccco2)cc(OC)c1.
What is the InChIKey of 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide?
The InChIKey is HAGMXZNKOKEUFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-26-20-11-18(12-21(13-20)27-2)23-22(25)16-24(15-19-9-6-10-28-19)14-17-7-4-3-5-8-17/h3-13H,14-16H2,1-2H3,(H,23,25).
What are the key properties of 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide?
2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide has a molecular weight of 380.44 g/mol, XLogP of 3.94, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(furan-2-ylmethyl)amino]-N-(3,5-dimethoxyphenyl)acetamide is sourced from PubChem (CID 55354188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).